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CHEBI:4583 - Dihydrosamidin

ChEBI IDCHEBI:4583
ChEBI NameDihydrosamidin
Stars
Last Modified25 February 2016
DownloadsMolfile
FormulaC21H24O7
Net Charge0
Average Mass388.416
Monoisotopic Mass388.15220
SMILESCC(=O)O[C@@H]1c2c(ccc3ccc(=O)oc23)OC(C)(C)[C@@H]1OC(=O)CC(C)C
InChIInChI=1S/C21H24O7/c1-11(2)10-16(24)27-20-19(25-12(3)22)17-14(28-21(20,4)5)8-6-13-7-9-15(23)26-18(13)17/h6-9,11,19-20H,10H2,1-5H3/t19-,20-/m1/s1
InChIKeyALKTVPFKDYZFGA-WOJBJXKFSA-N
ChEBI Ontology
Outgoing Relation(s)
Dihydrosamidin (CHEBI:4583) is a coumarins (CHEBI:23403)
Synonym  Source
DihydrosamidinKEGG COMPOUND
Manual XrefsDatabases
C09260KEGG COMPOUND
C00002468KNApSAcK
LSM-3429LINCS
Registry NumbersSources
CAS:6005-18-1KEGG COMPOUND